SCHEMBL9003285

SCHEMBL9003285

CN(CCO)CCNC(=O)CO

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.38
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
LGALS1 P09382 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NAAA Q02083 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ACKR3 P25106 1/20 0.31
MAPK1 P28482 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8323460 0.86 NAAA (0.48) DNM1MEN1KMT2ALGALS1NAAA
SCHEMBL8322672 0.86 DNM1 (0.37) DNM1MEN1KMT2AMAPTLGALS1
SCHEMBL8323458 0.82 DNM1 (0.42) DNM1MEN1KMT2ALGALS1NAAA
SCHEMBL25204410 0.81 MAPT (0.35) DNM1MEN1KMT2AMAPTKDM4E
SCHEMBL9547380 0.81 KDM4E (0.44) KDM4EALDH1A1MAPK1
SCHEMBL1387314 0.80 DNM1 (0.55) DNM1MAPTLGALS1ALDH1A1ACKR3
SCHEMBL9547373 0.79 MAPT (0.33) DNM1MEN1KMT2AMAPT
SCHEMBL14436497 0.79 MAPT (0.33) DNM1MEN1KMT2AMAPT
SCHEMBL7778641 0.78 CA12 (0.37) DNM1MEN1KMT2AMAPTKDM4E
SCHEMBL8809201 0.77 DNM1 (0.71) DNM1MEN1KMT2AMAPTNAAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0733045-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1996-09-25 EP disclosed
WO-1995015952-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1995-06-15 WO disclosed